0 mol 17 unq 0 iso 0 dist 7.96836 5.21083 7.34681 4.43871 6.64199 4.2802 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 9.50568 10.2834 5.52834 10.5217 9.39402 10.1829 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.4343 6.39142 5.35252 8.68072 8.52681 8.12843 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.4343 6.39142 5.35252 6.69623 9.98769 9.72202 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 7.05327 6.64431 5.06188 6.79361 9.40291 9.57893 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 7.05327 6.64431 5.06188 8.81303 7.94814 7.88988 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 7.05327 6.64431 5.06188 10.5726 9.55632 8.00934 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.50028 5.19187 7.45777 11.7078 5.88827 7.85784 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.50028 5.19187 7.45777 16.0942 9.66175 14.3054 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 7.6104 13.468 7.2118 11.4698 5.13041 4.12785 numMergedOcc 0
10 mol 87 unq 0 iso 0 dist 9.99609 12.809 9.90256 5.77895 9.20673 13.3292 numMergedOcc 0
11 mol 87 unq 1 iso 0 dist 9.99609 8.37496 7.57471 5.77895 9.20673 6.90315 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.29879 6.92975 5.79195 9.60776 8.98028 4.37065 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 6.29879 6.53637 9.2759 9.60776 8.98028 15.7191 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 6.29879 11.1722 8.76088 9.60776 8.98028 13.5318 numMergedOcc 0
15 mol 159 unq 0 iso 0 dist 9.5915 9.65752 9.9368 4.86107 8.61788 13.1056 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 6.26373 4.72853 7.20545 4.03388 7.20131 6.39898 numMergedOcc 0
17 mol 188 unq 0 iso 0 dist 7.82113 4.07548 8.1907 5.20357 7.50005 8.6599 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 8.96503 4.79799 5.86839 8.98996 4.93303 4.51847 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 8.96503 4.79799 5.86839 8.73701 9.95859 10.9814 numMergedOcc 0
20 mol 212 unq 0 iso 0 dist 8.31372 5.30451 7.6819 4.45056 9.49715 9.36407 numMergedOcc 0
21 mol 212 unq 1 iso 0 dist 8.31372 4.71691 6.36102 4.45056 9.49715 6.05395 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 6.55222 13.0572 8.86185 14.2967 9.58325 6.16212 numMergedOcc 0
